2-butylsulfanyl-5-[(4-cyclohexylphenyl)methyl]-6-methyl-1H-pyrimidin-4-one

Systemtic Name: 2-butylsulfanyl-5-[(4-cyclohexylphenyl)methyl]-6-methyl-1H-pyrimidin-4-one Openeye Name: 2-butylsulfanyl-5-[(4-cyclohexylphenyl)methyl]-6-methyl-1H-pyrimidin-4-one CAS Name: 2-(butylthio)-5-[(4-cyclohexylphenyl)methyl]-6-methyl-1H-pyrimidin-4-one IUPAC Name: 2-butylsulfanyl-5-[(4-cyclohexylphenyl)methyl]-6-methyl-1H-pyrimidin-4-one Traditional Name: 2-(butylthio)-5-(4-cyclohexylbenzyl)-6-methyl-1H-pyrimidin-4-one Formula: C22H30N2OS MolecularWeight: 370.5514

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NC(=O)C(=C(N1)C)CC2=CC=C(C=C2)C3CCCCC3

Isomeric SMILES

CCCCSC1=NC(=O)C(=C(N1)C)CC2=CC=C(C=C2)C3CCCCC3

InChI

InChI=1S/C22H30N2OS/c1-3-4-14-26-22-23-16(2)20(21(25)24-22)15-17-10-12-19(13-11-17)18-8-6-5-7-9-18/h10-13,18H,3-9,14-15H2,1-2H3,(H,23,24,25)